Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.39 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8767164 | 0.89 | NFE2L2 (0.44) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL17655002 | 0.87 | HTR1A (0.38) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL8768427 | 0.83 | HRH3 (0.49) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL17655004 | 0.83 | HRH3 (0.40) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL16582474 | 0.83 | NFE2L2 (0.53) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL8767576 | 0.82 | HTR1A (0.38) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL8961311 | 0.81 | ITGB3 (0.47) | NFE2L2HRH3HPGDPTGESHDAC3 | |
| SCHEMBL8766593 | 0.81 | NFE2L2 (0.47) | NFE2L2HRH3HTR1AHTR1DHTR1B | |
| SCHEMBL17655003 | 0.79 | NFE2L2 (0.44) | NFE2L2HRH3HPGD | |
| SCHEMBL8767920 | 0.78 | ESR2 (0.41) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |